3-(2-azanylethoxy)-N-[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(2-azanylethoxy)-N-[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-(2-aminoethoxy)-N-[3-chloro-4-(2-pyridylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(2-aminoethoxy)-N-[3-chloro-4-(2-pyridinylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: 3-(2-aminoethoxy)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [3-(2-aminoethoxy)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-[3-chloro-4-(2-pyridylmethoxy)phenyl]amine Formula: C19H18ClN7O2 MolecularWeight: 411.84492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=C3C(=NN4)OCCN)Cl

Isomeric SMILES

C1=CC=NC(=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=C3C(=NN4)OCCN)Cl

InChI

InChI=1S/C19H18ClN7O2/c20-14-9-12(4-5-15(14)29-10-13-3-1-2-7-22-13)25-17-16-18(24-11-23-17)26-27-19(16)28-8-6-21/h1-5,7,9,11H,6,8,10,21H2,(H2,23,24,25,26,27)